2-[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]thio]-N-[4-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]thio]-N-(4-pyrrolidinosulfonylphenyl)acetamide Formula: C17H23N5O4S3 MolecularWeight: 457.59062

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=NN=C(S1)SCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

COCCNC1=NN=C(S1)SCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C17H23N5O4S3/c1-26-11-8-18-16-20-21-17(28-16)27-12-15(23)19-13-4-6-14(7-5-13)29(24,25)22-9-2-3-10-22/h4-7H,2-3,8-12H2,1H3,(H,18,20)(H,19,23)